Basic information
- CAS
67803-76-3- Standard SMILES
CCCNc1ccc(NC)c2c1C(=O)c1ccccc1C2=O- InChIKey
MPCGNFQQDUHSJV-UHFFFAOYSA-N- Molecular formula
- C18H18N2O2
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.13682782
Names & identifiers
- Preferred name
- 1-(Methylamino)-4-(propylamino)anthracene-9,10-dione
- IUPAC
- 1-(methylamino)-4-(propylamino)anthracene-9,10-dione
Names & synonyms
1-(Methylamino)-4-(propylamino)anthracene-9,10-dione67803-76-3SCHEMBL14582002DTXSID70744202
Database identifiers
- CAS
67803-76-3- PubChem CID
- 71210144
- DTXSID
DTXSID70744202
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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